Antibiotic OA 6129D
AlkaPlorer ID: AK033445
Synonym: '', 'OA-6129D', 'Antibiotic OA-6129D', 'Antibiotic OA 6129D'
IUPAC Name: (2S,3S,5R,6R)-3-[2-[3-[[(2S)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-6-[(1S)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Structure
SMILES: C[C@H](O)[C@@H]1C(=O)N2[C@@H]1C[C@H](SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)CO)[C@@H]2C(=O)O
InChI: InChI=1S/C20H33N3O8S/c1-10(25)14-11-8-12(15(19(30)31)23(11)18(14)29)32-7-6-21-13(26)4-5-22-17(28)16(27)20(2,3)9-24/h10-12,14-16,24-25,27H,4-9H2,1-3H3,(H,21,26)(H,22,28)(H,30,31)/t10-,11+,12-,14-,15+,16+/m0/s1
InChIKey: IDHUQZYNJINFBS-MRISCKSKSA-N
Source
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Properties Information
Molecule Weight: 475.56400000000025
TPSA？: 176.5
MolLogP？: -1.8451999999999948
Number of H-Donors: 6
Number of H-Acceptors: 8
RingCount: 2
Activities Information
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